7-{4-[4-(acetyloxy)benzoyl]piperazin-1-yl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Chemical Structure Depiction of
7-{4-[4-(acetyloxy)benzoyl]piperazin-1-yl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
7-{4-[4-(acetyloxy)benzoyl]piperazin-1-yl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Compound characteristics
| Compound ID: | 5082-2438 |
| Compound Name: | 7-{4-[4-(acetyloxy)benzoyl]piperazin-1-yl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid |
| Molecular Weight: | 481.48 |
| Molecular Formula: | C25 H24 F N3 O6 |
| Smiles: | CCN1C=C(C(O)=O)C(c2cc(c(cc12)N1CCN(CC1)C(c1ccc(cc1)OC(C)=O)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6846 |
| logD: | -1.5017 |
| logSw: | -2.4323 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.326 |
| InChI Key: | PXKMJQFCCWMDGM-UHFFFAOYSA-N |